1-[(1S,2S,3S,4R,5R)-3-Hydroxy-4-(4-morpholinyl)-6,8-dioxabicyclo[3.2.1]oct-2-yl]-3-phenylurea
12427
Reference
1-[(1S,2S,3S,4R,5R)-3-Hydroxy-4-(4-morpholinyl)-6,8-dioxabicyclo[3.2.1]oct-2-yl]-3-phenylurea Structure
Systematic / IUPAC Name: 1-[(1S,2S,3S,4R,5R)-3-Hydroxy-4-morpholin-4-yl-6,8-dioxabicyclo[3.2.1]octan-2-yl]-3-phenylurea
ID: Reference12427
Other Names: NAT17-347164
Formula: C17H23N3O5
Spectral Data
1-[(1S,2S,3S,4R,5R)-3-Hydroxy-4-(4-morpholinyl)-6,8-dioxabicyclo[3.2.1]oct-2-yl]-3-phenylurea mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 894 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 4/6/2023 9:15:56 AM |
Identificators
| InChI | InChI=1S/C17H23N3O5/c21-15-13(19-17(22)18-11-4-2-1-3-5-11)12-10-24-16(25-12)14(15)20-6-8-23-9-7-20/h1-5,12-16,21H,6-10H2,(H2,18,19,22)/t12-,13-,14-,15+,16-/m1/s1 |
| InChI Key | BIZJGGGSOWBYGA-DGXTUMSLSA-N |
| Canonical SMILES | C1COCCN1C2C(C(C3COC2O3)NC(=O)NC4=CC=CC=C4)O |
| CAS | |
| Splash | |
| Other Names | NAT17-347164 |